(5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one

C17H23N3O3 — CID 124960687

IUPAC(5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one
SMILESCC(=O)N1CCC(Cc2cccc(N3C[C@@H](C)OC3=O)n2)CC1
InChIInChI=1S/C17H23N3O3/c1-12-11-20(17(22)23-12)16-5-3-4-15(18-16)10-14-6-8-19(9-7-14)13(2)21/h3-5,12,14H,6-11H2,1-2H3/t12-/m1/s1
InChIKeyGWHXMCPLUMGISY-GFCCVEGCSA-N
MW317.39 g/mol
LogP2.23
Rot. Bonds3

About (5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one

(5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one (PubChem CID 124960687) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is (5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one
PubChem CID124960687
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC Name(5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one
SMILESCC(=O)N1CCC(Cc2cccc(N3C[C@@H](C)OC3=O)n2)CC1
InChIInChI=1S/C17H23N3O3/c1-12-11-20(17(22)23-12)16-5-3-4-15(18-16)10-14-6-8-19(9-7-14)13(2)21/h3-5,12,14H,6-11H2,1-2H3/t12-/m1/s1
InChIKeyGWHXMCPLUMGISY-GFCCVEGCSA-N
XLogP2.23
TPSA62.74 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one with MolForge

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Related Compounds

1-[(4R)-4-[(6-bromo-2-pyridinyl)methyl]azepan-1-yl]ethanone
CID 95804470
5-methyl-3-(6-piperidin-4-yl-2-pyridinyl)-1,3-oxazolidin-2-one
CID 110099061
1-[4-[[6-(5-methyl-1H-pyrazol-3-yl)-2-pyridinyl]methyl]piperidin-1-yl]ethanone
CID 110101867
5-methyl-3-[6-(1-propan-2-ylpiperidin-4-yl)-2-pyridinyl]-1,3-oxazolidin-2-one
CID 110099063
1-[3-[[6-(cyclopentylamino)-2-pyridinyl]methyl]pyrrolidin-1-yl]ethanone
CID 110090129
1-[4-[[6-[(5-methyl-1,2-oxazol-3-yl)amino]-2-pyridinyl]methyl]piperidin-1-yl]ethanone
CID 95815297
5-methyl-3-pyridin-2-yl-1,3-oxazolidin-2-one
CID 102338604
5-methyl-3-[6-(piperidin-4-ylmethyl)pyrimidin-4-yl]-1,3-oxazolidin-2-one
CID 110099244
1-[(3S)-3-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]methyl]pyrrolidin-1-yl]ethanone
CID 125014137
3-[5-[(1-acetylpiperidin-4-yl)methyl]pyrazin-2-yl]-4-methyl-1,3-oxazolidin-2-one
CID 110099031
(4S)-3-[6-[(1-acetylpiperidin-4-yl)methyl]pyrazin-2-yl]-4-benzyl-1,3-oxazolidin-2-one
CID 125020370
1-[(4S)-4-[[6-(2-methoxyethylamino)-2-pyridinyl]methyl]azepan-1-yl]ethanone
CID 95825077

Frequently Asked Questions

What is the IUPAC name of (5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one?
The IUPAC name of (5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one (CID 124960687) is (5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one.
What is the SMILES notation for (5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one?
The canonical SMILES for (5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one is CC(=O)N1CCC(Cc2cccc(N3C[C@@H](C)OC3=O)n2)CC1.
What is the InChIKey of (5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one?
The InChIKey is GWHXMCPLUMGISY-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H23N3O3/c1-12-11-20(17(22)23-12)16-5-3-4-15(18-16)10-14-6-8-19(9-7-14)13(2)21/h3-5,12,14H,6-11H2,1-2H3/t12-/m1/s1.
What are the key properties of (5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one?
(5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one has a molecular weight of 317.39 g/mol, XLogP of 2.23, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-[6-[(1-acetylpiperidin-4-yl)methyl]-2-pyridinyl]-5-methyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 124960687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).